[HTML][HTML] NLO potential exploration for D–π–A heterocyclic organic compounds by incorporation of various π-linkers and acceptor units
Heterocyclic compounds with excellent nonlinear optical (NLO) properties are highly
significant and have many potentials uses in various fields such as nuclear science …
significant and have many potentials uses in various fields such as nuclear science …
Influence of azo-based donor modifications on nonlinear optical amplitude of D-π-A based organic chromophores: A DFT/TD-DFT exploration
Organic heterocyclic fused ring compounds possess remarkable nonlinear optical (NLO)
amplitude, are potentially employed in optical computing and nano-photonics. Herein …
amplitude, are potentially employed in optical computing and nano-photonics. Herein …
Structural modulation of π-conjugated linkers in D–π–A dyes based on triphenylamine dicyanovinylene framework to explore the NLO properties
A donor–π–acceptor type series of Triphenylamine–dicyanovinylene-based chromophores
(DPMN1–DPMN11) was designed theoretically by the structural tailoring of π-linkers of …
(DPMN1–DPMN11) was designed theoretically by the structural tailoring of π-linkers of …
Preparation, crystal structure, supramolecular assembly, and DFT studies of two organic salts bearing pyridine and pyrimidine
The effective preparation of two new pyrimidine-and pyridine-based organic crystalline salts
with substituted acidic moieties (ie,(Z)-4-(naphthalen-2-ylamino)-4-oxobut-2-enoic acid …
with substituted acidic moieties (ie,(Z)-4-(naphthalen-2-ylamino)-4-oxobut-2-enoic acid …
[HTML][HTML] Efficient synthesis of imine-carboxylic acid functionalized compounds: Single crystal, Hirshfeld surface and quantum chemical exploration
Two aminobenzoic acid based crystalline imines (HMBA and DHBA) were synthesized
through a condensation reaction of 4-aminobenzoic acid and substituted benzaldehydes …
through a condensation reaction of 4-aminobenzoic acid and substituted benzaldehydes …
Green synthesis of chromonyl chalcone and pyrazoline as potential antimicrobial agents–DFT, molecular docking and antimicrobial studies
The synthesis of biologically important chromonyl chalcone and pyrazoline derivative, via an
impressive as well as an eco-friendly green approach, using LaCl 3/nano SiO 2 catalyst …
impressive as well as an eco-friendly green approach, using LaCl 3/nano SiO 2 catalyst …
Influence of end-capped modifications in the nonlinear optical amplitude of nonfullerene-based chromophores with a D− π–A architecture: a DFT/TDDFT study
Nonlinear optical (NLO) materials have several uses in many fields such as solid physics,
biology, medicine, nuclear physics, and material research. Therefore, a series of …
biology, medicine, nuclear physics, and material research. Therefore, a series of …
Antibacterial metal complexes of o‐sulfamoylbenzoic acid: Synthesis, characterization, and DFT study
Herein, antibacterial transition metal complexes of ML2 type having o‐sulfamoylbenzoic
acid as ligand were synthesized from saccharin. All characterization techniques confirmed …
acid as ligand were synthesized from saccharin. All characterization techniques confirmed …
[HTML][HTML] Designing electron-deficient diketone unit based non-fused ring acceptors with amplified optoelectronic features for highly efficient organic solar cells: a DFT …
Organic solar cells (OSCs) made of electron-acceptor and electron-donor materials have
significantly developed in the last decade, demonstrating their enormous potential in cutting …
significantly developed in the last decade, demonstrating their enormous potential in cutting …
A theoretical approach towards designing of banana shaped non-fullerene chromophores using efficient acceptors moieties: Exploration of their NLO response …
M Khalid, S Naseer, MS Tahir, I Shafiq… - Optical and Quantum …, 2023 - Springer
Current research has focused on utilization of non-fullerene based organic materials for the
advancement of nonlinear optical (NLO) based technology. The reference compound …
advancement of nonlinear optical (NLO) based technology. The reference compound …